3-(1-benzofuran-2-ylcarbonyl)-4-oxidanyl-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one

Systemtic Name: 3-(1-benzofuran-2-ylcarbonyl)-4-oxidanyl-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one Openeye Name: 3-(benzofuran-2-carbonyl)-1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2-(4-isopropylphenyl)-2H-pyrrol-5-one CAS Name: 3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-1-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one IUPAC Name: 3-(1-benzofuran-2-carbonyl)-1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one Traditional Name: 4-(benzofuran-2-carbonyl)-1-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-hydroxy-5-p-cumenyl-3-pyrrolin-2-one Formula: C31H25N3O4S2 MolecularWeight: 567.6779

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4)O)C(=O)C5=CC6=CC=CC=C6O5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4)O)C(=O)C5=CC6=CC=CC=C6O5

InChI

InChI=1S/C31H25N3O4S2/c1-18(2)20-12-14-21(15-13-20)26-25(27(35)24-16-22-10-6-7-11-23(22)38-24)28(36)29(37)34(26)30-32-33-31(40-30)39-17-19-8-4-3-5-9-19/h3-16,18,26,36H,17H2,1-2H3